Can the conformation of flexible hydroxyl groups be constrained by simple NMR crystallography approaches? the case of the quercetin solid forms

Solid State Nuclear Magnetic Resonance

Volumn 65, Issue , 2015, Pages 21-28

  Filip, Xenia ^a   Filip, Claudiu ^a  

^a NATIONAL INSTITUTE FOR RESEARCH AND DEVELOPMENT OF ISOTOPIC AND MOLECULAR TECHNOLOGIES   (Romania)

Author keywords

CASTEP; Conformational analysis; NMR crystallography; Quercetin

Indexed keywords

ATOMS; COMPUTATION THEORY; CRYSTAL STRUCTURE; FLAVONOIDS; HYDROGEN; HYDROGEN BONDS; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; PHENOLS; QUANTUM THEORY; SINGLE CRYSTALS; X RAY DIFFRACTION;

CASTEP; CONFORMATIONAL ANALYSIS; FIRST PRINCIPLES; HYDROGEN BONDING NETWORK; NMR CRYSTALLOGRAPHY; QUANTUM MECHANICAL COMPUTATIONS; QUERCETIN; X-RAY SINGLE CRYSTAL STRUCTURES;

X RAY CRYSTALLOGRAPHY;

HYDROXIDE; HYDROXIDE ION; QUERCETIN;

CHEMICAL STRUCTURE; CHEMISTRY; CONFORMATION; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; PROCEDURES; QUANTUM THEORY; X RAY CRYSTALLOGRAPHY;

CRYSTALLOGRAPHY, X-RAY; HYDROXIDES; MAGNETIC RESONANCE SPECTROSCOPY; MODELS, MOLECULAR; MOLECULAR CONFORMATION; QUANTUM THEORY; QUERCETIN;

EID: 84924365425     PISSN: 09262040     EISSN: 15273326     Source Type: Journal    
DOI: 10.1016/j.ssnmr.2014.10.006     Document Type: Article

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